N-[4-(furan-2-yl)butan-2-yl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[4-(furan-2-yl)butan-2-yl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
N-[4-(furan-2-yl)butan-2-yl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-1190 |
| Compound Name: | N-[4-(furan-2-yl)butan-2-yl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C22 H22 N6 O5 |
| Smiles: | CC(CCc1ccco1)NC(c1nc(C2C(N(C)C(N(c3ccc(C)cc3)N=2)=O)=O)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0742 |
| logD: | 3.0742 |
| logSw: | -3.4598 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.563 |
| InChI Key: | OCWSTNDDUVYJKJ-AWEZNQCLSA-N |